HRID2311644

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID962

Water

H2O

2 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID15908

1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide

C8H17N3

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID88358

Phosphonic acid, p-aminobenzyl-, diethyl ester

C11H18NO3P

HCID22221207

未命名化合物

PRODUCTS

生成物

结构：CCOP(=O)(Cc1ccc(NC(=O)CCc2c(C)noc2-c2ccccc2)cc1)OCC

HCID86591382

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b8a2acb778a54311b435cca744588859
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[CH2:46]([N:47]=[C:48]=[N:49][CH2:50][CH2:51][CH2:52][N:53]([CH3:54])[CH3:55])[CH3:56].[CH3:17][c:18]1[n:19][o:20][c:21](-[c:28]2[cH:29][cH:30][cH:31][cH:32][cH:33]2)[c:22]1[CH2:23][CH2:24][C:25](=[O:26])[OH:27].[CH3:58][N:59]([CH3:60])[CH:61]=[O:62].[ClH:45].[NH2:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][P:7]([O:8][CH2:9][CH3:10])([O:11][CH2:12][CH3:13])=[O:14])[cH:15][cH:16]1.[OH2:34].[OH2:57].[OH:35][n:36]1[c:37]2[cH:38][cH:39][cH:40][cH:41][c:42]2[n:43][n:44]1>>[NH:1]([c:2]1[cH:3][cH:4][c:5]([CH2:6][P:7]([O:8][CH2:9][CH3:10])([O:11][CH2:12][CH3:13])=[O:14])[cH:15][cH:16]1)[C:25]([CH2:24][CH2:23][c:22]1[c:18]([CH3:17])[n:19][o:20][c:21]1-[c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1)=[O:26]